Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields (Q61311660)

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Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields
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    Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields (English)
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    P. J. Stephens
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    F. J. Devlin
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    C. F. Chabalowski
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    M. J. Frisch
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    November 1994
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    98
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    45
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    11623-11627
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